Geometry & MOs

Info

ID:	206042
PubChem CID:	80193351
Reduced:	ClSN2O2C13H21 (1)
Stoich.:	ABC2D2E13F21 (1)
Weight, g/mol:	321.035705
ΔH_f, kcal/mol:	-93.05
Dipole, Da:	7.81
IP(EA), eV:	-8.94(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-chloro-5-(chloromethyl)phenyl]sulfonyl-3,3-dimethylpyrrolidine

Drug info:

PubChemData

Smile

CCN1C=C(C=C1CCl)S(=O)(=O)N2CCC(C2)(C)C

DOS

IR

Vibrations